SCHEMBL4066836

SCHEMBL4066836

COC(=O)c1ccsc1NC(N)=O

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.67
MEN1 O00255 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
KDM4E B2RXH2 3/20 0.63
POLB P06746 1/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
CNR2 P34972 1/20 0.56
PTK2 Q05397 1/20 0.56
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
MAPK10 P53779 2/20 0.53
ALDH1A1 P00352 1/20 0.53
ALOX12 P18054 1/20 0.53
MAPT P10636 1/20 0.51
MAPK8 P45983 1/20 0.49
FLT3 P36888 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11578842 0.84 KMT2A (0.69) KMT2AMEN1SMN1; SMN2KDM4EPOLB
SCHEMBL10627226 0.84 PTK2 (0.50) KMT2AMEN1SMN1; SMN2KDM4EPOLB
SCHEMBL15440489 0.84 HPGD (0.53) KMT2AMEN1SMN1; SMN2KDM4ENPC1
SCHEMBL1680689 0.82 PTK2 (0.73) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL13700873 0.82 KMT2A (0.57) KMT2AMEN1SMN1; SMN2KDM4EPOLB
SCHEMBL5550829 0.80 PTPN2 (0.68) KMT2AMEN1SMN1; SMN2NPC1RAB9A
SCHEMBL16838134 0.80 KMT2A (0.63) KMT2AMEN1SMN1; SMN2KDM4EPOLB
SCHEMBL1037708 0.80 KMT2A (0.63) KMT2AMEN1SMN1; SMN2KDM4EPOLB
SCHEMBL7930548 0.80 KMT2A (0.63) KMT2AMEN1SMN1; SMN2KDM4EPOLB
SCHEMBL4753012 0.80 KMT2A (0.63) KMT2AMEN1SMN1; SMN2KDM4EPOLB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293735-B2 Thienopyrimidine derivatives as P13K inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2012-10-23 US disclosed
US-8293735-B2 Thienopyrimidine derivatives as P13K inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2012-10-23 US disclosed
US-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-01-27 US disclosed
US-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2011-01-27 US disclosed
EP-1686999-B1 PYRAZOLE DERIVATIVES AS INHIBITORS OF RECEPTOR TYROSINE KINASES ASTRAZENECA AB (SE) 2009-07-01 EP disclosed
WO-2009053715-A1 THIENOPYRIMIDIENE DERIVATIVES AS PI3K INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2009-04-30 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110021496-A1 THIENOPYRIMIDINE DERIVATIVES AS P13K INHIBITORS PIK3CA, PIK3CD, PIK3CB KMT2A 3035/4885MEN1 2628/4885SMN1; SMN2 2967/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.